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Interactive Nanothread Structures

Rotate with fingers or mouse. Zoom with pinch (tablet), wheel (mouse), or two fingers (trackpad). Spin with the buttons.

Dark grey atoms are carbon.  White atoms are hydrogen.

Single Polytwistane Nanothread

 
 

A short section of polytwistane, a simple chiral nanothread. About 50 different fully saturated degree-6 nanothreads such as polytwistane have been enumerated. Polytwistane has an infinitely long unit cell. NMR suggests that the "stiff-chiral-3" structure is most consistent so far with the experimental data on nanothreads. See it below and Nano Letters 18, 4934 (2018). Here is the pdb file.

Polytwistane Nanothread Crystal

 
 

Nanothreads appear to spontaneously self-assemble into crystal bundles such as these, whether benzene reactant is single crystal or not. See JACS 139, 16343 (2017). Here is the pdb file.

Single Stiff-chiral-3 Nanothread

 
 

Stiff-chiral-3 is more complex nanothread. Like the majority of nanothread structures, it appears capable of packing into the observed hexagonal crystal. Here is the pdb file.

Single Tube (3,0) Nanothread

 
 

Tube (3,0) was one of the two nanothread structures first proposed in 2001. It is one of the simplest nanothreads, and can be thought of as consisting of stacked cyclohexane rings. It's structure is not consistent with experiment. Here is the pdb file.

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A National Science Foundation Phase I Center for Chemical Innovation

We acknowledge support from NSF CHE-1832471 for the Center for Nanothread Chemistry. Any opinions, findings, and conclusions or recommendations expressed here are those of the authors and do not necessarily reflect the views of the National Science Foundation (NSF).

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